CID 11810914

148398-19-0

Structural Information

Molecular Formula
C25H28O3
SMILES
CC1=CC(=C(C(=C1)CC2=C(C=C(C(=C2)C)O)C)O)CC3=C(C=C(C(=C3)C)O)C
InChI
InChI=1S/C25H28O3/c1-14-6-21(12-19-8-17(4)23(26)10-15(19)2)25(28)22(7-14)13-20-9-18(5)24(27)11-16(20)3/h6-11,26-28H,12-13H2,1-5H3
InChIKey
GOWFRAUGTCYVPS-UHFFFAOYSA-N
Compound name
2,6-bis[(4-hydroxy-2,5-dimethylphenyl)methyl]-4-methylphenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

341
Patents

376.20386 Da
Monoisotopic Mass

6.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 377.21114 196.8
[M+Na]+ 399.19308 213.8
[M+NH4]+ 394.23768 204.1
[M+K]+ 415.16702 205.0
[M-H]- 375.19658 203.1
[M+Na-2H]- 397.17853 204.5
[M]+ 376.20331 201.4
[M]- 376.20441 201.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe